2-(4-tert-butylphenyl)-4-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-4-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-oxazol-5(4H)-one
2-(4-tert-butylphenyl)-4-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2062-0319 |
| Compound Name: | 2-(4-tert-butylphenyl)-4-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 383.83 |
| Molecular Formula: | C21 H18 Cl N O4 |
| Smiles: | CC(C)(C)c1ccc(cc1)C1=NC(=C/c2cc3c(cc2[Cl])OCO3)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 5.5098 |
| logD: | 5.5098 |
| logSw: | -6.012 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.491 |
| InChI Key: | RBYGLEFRCLXHCP-UHFFFAOYSA-N |